O5-(2-cyanoethyl) O3-propan-2-yl 2-(diethoxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-(2-cyanoethyl) O3-propan-2-yl 2-(diethoxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-(2-cyanoethyl) O3-isopropyl 2-(diethoxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(diethoxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-(2-cyanoethyl) ester O3-propan-2-yl ester IUPAC Name: 5-O-(2-cyanoethyl) 3-O-propan-2-yl 2-(diethoxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(diethoxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-(2-cyanoethyl) ester O3-isopropyl ester Formula: C25H31N3O8 MolecularWeight: 501.52894

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=C(C(C(=C(N1)C)C(=O)OCCC#N)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C)OCC

Isomeric SMILES

CCOC(C1=C(C(C(=C(N1)C)C(=O)OCCC#N)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C)OCC

InChI

InChI=1S/C25H31N3O8/c1-6-33-25(34-7-2)22-21(24(30)36-15(3)4)20(17-10-8-11-18(14-17)28(31)32)19(16(5)27-22)23(29)35-13-9-12-26/h8,10-11,14-15,20,25,27H,6-7,9,13H2,1-5H3